methyl 3-(4-azanylpiperidin-1-yl)-5-(trifluoromethyl)benzoate

Systemtic Name: methyl 3-(4-azanylpiperidin-1-yl)-5-(trifluoromethyl)benzoate Openeye Name: methyl 3-(4-amino-1-piperidyl)-5-(trifluoromethyl)benzoate CAS Name: 3-(4-amino-1-piperidinyl)-5-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(4-aminopiperidin-1-yl)-5-(trifluoromethyl)benzoate Traditional Name: 3-(4-aminopiperidino)-5-(trifluoromethyl)benzoic acid methyl ester Formula: C14H17F3N2O2 MolecularWeight: 302.29219

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)N2CCC(CC2)N)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)N2CCC(CC2)N)C(F)(F)F

InChI

InChI=1S/C14H17F3N2O2/c1-21-13(20)9-6-10(14(15,16)17)8-12(7-9)19-4-2-11(18)3-5-19/h6-8,11H,2-5,18H2,1H3